ChemSpider 2D Image | N-(3-Bromobenzyl)-1-phenyl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxamide | C21H16BrN5O

N-(3-Bromobenzyl)-1-phenyl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC21H16BrN5O
  • Average mass434.289 Da
  • Monoisotopic mass433.053802 Da
  • ChemSpider ID65086114

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-1,2,3-Triazole-4-carboxamide, N-[(3-bromophenyl)methyl]-1-phenyl-5-(4-pyridinyl)- [ACD/Index Name]
N-(3-Brombenzyl)-1-phenyl-5-(4-pyridinyl)-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
N-(3-Bromobenzyl)-1-phenyl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
N-(3-Bromobenzyl)-1-phényl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
N-[(3-bromophenyl)methyl]-1-phenyl-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(3-bromophenyl)methyl]-1-phenyl-5-pyridin-4-yltriazole-4-carboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.695
Molar Refractivity: 113.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 116.27
ACD/KOC (pH 5.5): 1045.65
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 116.91
ACD/KOC (pH 7.4): 1051.37
Polar Surface Area: 73 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 295.9±7.0 cm3

Click to predict properties on the Chemicalize site


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